Carine Clavaguéra (Carine Clavaguera)

ResearcherID ORCID

Publication Activity (10 Years)

Years Active: 2017-2024
Publications (10 Years): 18

Top Venues

Chemphyschem : a European journal of chemical physics and physical chemistry

Physical chemistry chemical physics : PCCP

The journal of physical chemistry. B

Chemical science

CNRS

This page only lists publications with an associated author ORCID identifier.

Affiliation History

CNRS

France

CNRS Researcher :: Laboratoire de Chimie Physique, Paris Sud University

Publications

Jessica Bowles, Sascha Jähnigen, Federica Agostini, Rodolphe Vuilleumier, Anne Zehnacker-Rentien, Florent Calvo, Carine Clavaguéra
Vibrational circular dichroism spectroscopy with a classical polarizable force field: alanine in the gas and condensed phases. Chemphyschem : a European journal of chemical physics and physical chemistry (2024)
Jessica Bowles, Sascha Jähnigen, Federica Agostini, Rodolphe Vuilleumier, Anne Zehnacker-Rentien, Florent Calvo, Carine Clavaguéra
Vibrational Circular Dichroism Spectroscopy with a Classical Polarizable Force Field: Alanine in the Gas and Condensed Phases. Chemphyschem : a European journal of chemical physics and physical chemistry 25 (8) (2024)
Jessica Bowles, Sascha Jähnigen, Rodolphe Vuilleumier, Florent Calvo, Carine Clavaguéra, Federica Agostini
Influence of the environment on the infrared spectrum of alanine: An effective mode analysis. The Journal of chemical physics 158 (9) (2023)
Valeriu Cemortan, Thomas Simler, Jules Moutet, Arnaud Jaoul, Carine Clavaguéra, Grégory Nocton
Structure and bonding patterns in heterometallic organometallics with linear Ln-Pd-Ln motifs. Chemical science 14 (10) (2023)
Zhiwen Jiang, Carine Clavaguéra, Changjiang Hu, Sergey A Denisov, Shuning Shen, Feng Hu, Jun Ma, Mehran Mostafavi
Direct time-resolved observation of surface-bound carbon dioxide radical anions on metallic nanocatalysts. Nature communications 14 (1) (2023)
Valeriu Cemortan, Thomas Simler, Jules Moutet, Arnaud Jaoul, Carine Clavaguéra, Grégory Nocton
Structure and bonding patterns in heterometallic organometallics with linear Ln-Pd-Ln motifs. Chemical science 14 (10) (2023)
Julie Puyo-Fourtine, Marie Juillé, Jérôme Hénin, Carine Clavaguéra, Elise Duboué-Dijon
Consistent Picture of Phosphate-Divalent Cation Binding from Models with Implicit and Explicit Electronic Polarization. The journal of physical chemistry. B 126 (22) (2022)
Yining Jiang, Suvasthika Indrajith, Ariel Francis Perez Mellor, Thomas Buergi, Marc Lecouvey, Carine Clavaguéra, Enrico Bodo, Chantal Houée-Levin, Estelle Loire, Giel Berden, Jos Oomens, Debora Scuderi
Final Products of One-Electron Oxidation of Cyclic Dipeptides Containing Methionine Investigated by IRMPD Spectroscopy: Does the Free Radical Choose the Final Compound? The journal of physical chemistry. B 126 (48) (2022)
Rika Tandiana, Cécile Sicard-Roselli, Nguyen-Thi Van-Oanh, Stephan N Steinmann, Carine Clavaguéra
In-depth theoretical understanding of the chemical interaction of aromatic compounds with a gold nanoparticle. Physical chemistry chemical physics : PCCP 24 (41) (2022)
Carine Clavaguéra, Florian Thaunay, Gilles Ohanessian
Manifolds of low energy structures for a magic number of hydrated sulfate: SO42-(H2O)24. Physical chemistry chemical physics : PCCP 23 (42) (2021)
Mathieu Xémard, Sébastien Zimmer, Marie Cordier, Violaine Goudy, Louis Ricard, Carine Clavaguéra, Grégory Nocton
Lanthanidocenes: Synthesis, Structure, and Bonding of Linear Sandwich Complexes of Lanthanides. Journal of the American Chemical Society 140 (43) (2018)
Florian Thaunay, Chandramohan Jana, Carine Clavaguéra, Gilles Ohanessian
Strategy for Modeling the Infrared Spectra of Ion-Containing Water Drops. The journal of physical chemistry. A 122 (3) (2018)
Xiaojing Wu, Carine Clavaguéra, Louis Lagardère, Jean-Philip Piquemal, Aurélien de la Lande
AMOEBA Polarizable Force Field Parameters of the Heme Cofactor in Its Ferrous and Ferric Forms. Journal of chemical theory and computation 14 (5) (2018)
Irene Mustieles Marín, Thibault Cheisson, Rohit Singh-Chauhan, Christian Herrero, Marie Cordier, Carine Clavaguéra, Grégory Nocton, Audrey Auffrant
Electronic Structures of Mono-Oxidized Copper and Nickel Phosphasalen Complexes. Chemistry (Weinheim an der Bergstrasse, Germany) 23 (71) (2017)
Xiaojing Wu, Jean-Marie Teuler, Fabien Cailliez, Carine Clavaguéra, Dennis R Salahub, Aurélien de la Lande
Simulating Electron Dynamics in Polarizable Environments. Journal of chemical theory and computation 13 (9) (2017)
Arnaud Jaoul, Grégory Nocton, Carine Clavaguéra
Assessment of Density Functionals for Computing Thermodynamic Properties of Lanthanide Complexes. Chemphyschem : a European journal of chemical physics and physical chemistry 18 (19) (2017)
Violaine Goudy, Arnaud Jaoul, Marie Cordier, Carine Clavaguéra, Grégory Nocton
Tuning the Stability of Pd(IV) Intermediates Using a Redox Non-innocent Ligand Combined with an Organolanthanide Fragment. Journal of the American Chemical Society 139 (31) (2017)
Mathieu Xémard, Arnaud Jaoul, Marie Cordier, Florian Molton, Olivier Cador, Boris Le Guennic, Carole Duboc, Olivier Maury, Carine Clavaguéra, Grégory Nocton
Divalent Thulium Triflate: A Structural and Spectroscopic Study. Angewandte Chemie (International ed. in English) 56 (15) (2017)

Carine Clavaguéra.css-eqlu8i{font-size:small;padding-left:4px;} (Carine Clavaguera)

Publication Activity (10 Years)

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Carine Clavaguéra (Carine Clavaguera)